Compound Detail
CHEMBL5401464
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Basic Information
| ChEMBL ID | CHEMBL5401464 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | CJPXKROSTONSHK-LJQANCHMSA-N |
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
385.6
MW (Da)
7.07
ALogP
2
HBA
0
HBD
22.1
PSA (Ų)
0.42
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 2 meas. best 5.12
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Plasmodium falciparum CHEMBL364 | IC50 | 5.12 | 5.12 | 7600.0 | 1 |
| HEK293 CHEMBL614818 | IC50 | 4.51 | 4.51 | 30800.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Plasmodium falciparum | IC50 | = | 7600.0 | nM | 5.12 | Antiplasmodial activity against choloroquine-sensitive ring stage of Plasmodium ... | 38416027 |
| HEK293 | IC50 | = | 30800.0 | nM | 4.51 | Cytotoxicity against human HEK293 cells assessed as inhibition of cell viability... | 38416027 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 38416027 | 10.1021/acs.jnatprod.3c01072 | Plasmodium falciparum | 1 |
| 38416027 | 10.1021/acs.jnatprod.3c01072 | HEK293 | 1 |
Data from ChEMBL 36 via Core Engine